mp-6884-2/Cs2LiCoC6N6/harm

Harmonic properties

../../_images/fig_bandos_pr6205.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos9070.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo6205.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc25996.png

(a) Force constants w.r.t atomic distance

Summary

../../_images/fig_times11286.png

(a) Computation time